Structure Information
Structure

Compound Identification

SMILES

CCC(C)C\C(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=N/OS(O)(=O)=O

InChIKey

InChIKey=SPOQDEMWLUGCEW-FYRHTRITSA-N

Formula

C12H23NO9S2

Mass

389.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbohydrates and carbohydrate conjugates

Intermediate Tree Nodes

Monosaccharides - Hexoses - Glucosinolates

Direct Parent

Alkylglucosinolates

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Alkylglucosinolate - Glycosyl compound - S-glycosyl compound - Oxane - Monothioacetal - Organic sulfuric acid or derivatives - Secondary alcohol - Oxacycle - Polyol - Organoheterocyclic compound - Sulfenyl compound - Alcohol - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Primary alcohol - Organic nitrogen compound - Organic oxide - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkylglucosinolates. These are organic compounds containing a glucosinolate moiety that carries an alkyl chain.

External Descriptors

Not available

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